We investigate whether post-hoc model explanations are effective for diagnosing model errors--model debugging. In response to the challenge of explaining a model's prediction, a vast array of explanation methods have been proposed. Despite increasing use, it is unclear if they are effective. To start, we categorize \textit{bugs}, based on their source, into: ~\textit{data, model, and test-time} contamination bugs. For several explanation methods, we assess their ability to: detect spurious correlation artifacts (data contamination), diagnose mislabeled training examples (data contamination), differentiate between a (partially) re-initialized model and a trained one (model contamination), and detect out-of-distribution inputs (test-time contamination). We find that the methods tested are able to diagnose a spurious background bug, but not conclusively identify mislabeled training examples. In addition, a class of methods, that modify the back-propagation algorithm are invariant to the higher layer parameters of a deep network; hence, ineffective for diagnosing model contamination. We complement our analysis with a human subject study, and find that subjects fail to identify defective models using attributions, but instead rely, primarily, on model predictions. Taken together, our results provide guidance for practitioners and researchers turning to explanations as tools for model debugging.

Several machine learning models involve mapping a score vector to a probability vector. Usually, this is done by projecting the score vector onto a probability simplex, and such projections are often characterized as Lipschitz continuous approximations of the argmax function, whose Lipschitz constant is controlled by a parameter that is similar to a softmax temperature. The aforementioned parameter has been observed to affect the quality of these models and is typically either treated as a constant or decayed over time. In this work, we propose a method that adapts this parameter to individual training examples. The resulting method exhibits desirable properties, such as sparsity of its support and numerically efficient implementation, and we find that it significantly outperforms competing non-adaptive projection methods. In our analysis, we also derive the general solution of (Bregman) projections onto the (n, k)-simplex, a result which may be of independent interest.

Learning functions with high-dimensional outputs is critical in many applications, such as physical simulation and engineering design. However, collecting training examples for these applications is often costly, e.g., by running numerical solvers. The recent work (Li et al., 2022) proposes the first multi-fidelity active learning approach for high-dimensional outputs, which can acquire examples at different fidelities to reduce the cost while improving the learning performance. However, this method only queries at one pair of fidelity and input at a time, and hence has a risk of bringing in strongly correlated examples to reduce the learning efficiency. In this paper, we propose Batch Multi-Fidelity Active Learning with Budget Constraints (BMFAL-BC), which can promote the diversity of training examples to improve the benefit-cost ratio, while respecting a given budget constraint for batch queries.

This paper studies the problem of conducting self-supervised learning for node representation learning on graphs. Most existing self-supervised learning methods assume the graph is homophilous, where linked nodes often belong to the same class or have similar features. However, such assumptions of homophily do not always hold in real-world graphs. We address this problem by developing a decoupled self-supervised learning (DSSL) framework for graph neural networks.

Document intelligence automates the extraction of information from documents and supports many business applications. Recent self-supervised learning methods on large-scale unlabeled document datasets have opened up promising directions towards reducing annotation efforts by training models with self-supervised objectives. However, most of the existing document pretraining methods are still language-dominated.

Current long-tailed semi-supervised learning methods assume that labeled data exhibit a long-tailed distribution, and unlabeled data adhere to a typical predefined distribution (i.e., long-tailed, uniform, or inverse long-tailed). However, the distribution of the unlabeled data is generally unknown and may follow an arbitrary distribution. To tackle this challenge, we propose a Controllable Pseudo-label Generation (CPG) framework, expanding the labeled dataset with the progressively identified reliable pseudo-labels from the unlabeled dataset and training the model on the updated labeled dataset with a known distribution, making it unaffected by the unlabeled data distribution. Specifically, CPG operates through a controllable self-reinforcing optimization cycle: (i) at each training step, our dynamic controllable filtering mechanism selectively incorporates reliable pseudo-labels from the unlabeled dataset into the labeled dataset, ensuring that the updated labeled dataset follows a known distribution; (ii) we then construct a Bayes-optimal classifier using logit adjustment based on the updated labeled data distribution; (iii) this improved classifier subsequently helps identify more reliable pseudo-labels in the next training step. We further theoretically prove that this optimization cycle can significantly reduce the generalization error under some conditions. Additionally, we propose a class-aware adaptive augmentation module to further improve the representation of minority classes, and an auxiliary branch to maximize data utilization by leveraging all labeled and unlabeled samples. Comprehensive evaluations on various commonly used benchmark datasets show that CPG achieves consistent improvements, surpassing state-of-the-art methods by up to $\textbf{15.97%}$ in accuracy. The code is available at https://github.com/yaxinhou/CPG.

In-context learning with attention enables large neural networks to make context-specific predictions by selectively focusing on relevant examples. Here, we adapt this idea to supervised learning procedures such as lasso regression and gradient boosting, for tabular data. Our goals are to (1) flexibly fit personalized models for each prediction point and (2) retain model simplicity and interpretability. Our method fits a local model for each test observation by weighting the training data according to attention, a supervised similarity measure that emphasizes features and interactions that are predictive of the outcome. Attention weighting allows the method to adapt to heterogeneous data in a data-driven way, without requiring cluster or similarity pre-specification. Further, our approach is uniquely interpretable: for each test observation, we identify which features are most predictive and which training observations are most relevant. We then show how to use attention weighting for time series and spatial data, and we present a method for adapting pretrained tree-based models to distributional shift using attention-weighted residual corrections. Across real and simulated datasets, attention weighting improves predictive performance while preserving interpretability, and theory shows that attention-weighting linear models attain lower mean squared error than the standard linear model under mixture-of-models data-generating processes with known subgroup structure.

Self supervised learning (SSL) is a machine learning paradigm where models learn to understand the underlying structure of data without explicit supervision from labeled samples. The acquired representations from SSL have demonstrated useful for many downstream tasks including clustering, and linear classification, etc. To ensure smoothness of the representation space, most SSL methods rely on the ability to generate pairs of observations that are similar to a given instance. However, generating these pairs may be challenging for many types of data. Moreover, these methods lack consideration of uncertainty quantification and can perform poorly in out-of-sample prediction settings. To address these limitations, we propose Gaussian process self supervised learning (GPSSL), a novel approach that utilizes Gaussian processes (GP) models on representation learning. GP priors are imposed on the representations, and we obtain a generalized Bayesian posterior minimizing a loss function that encourages informative representations. The covariance function inherent in GPs naturally pulls representations of similar units together, serving as an alternative to using explicitly defined positive samples. We show that GPSSL is closely related to both kernel PCA and VICReg, a popular neural network-based SSL method, but unlike both allows for posterior uncertainties that can be propagated to downstream tasks. Experiments on various datasets, considering classification and regression tasks, demonstrate that GPSSL outperforms traditional methods in terms of accuracy, uncertainty quantification, and error control.

Data attribution methods identify which training examples are responsible for a model's predictions, but their sensitivity to distributional perturbations undermines practical reliability. We present a unified framework for certified robust attribution that extends from convex models to deep networks. For convex settings, we derive Wasserstein-Robust Influence Functions (W-RIF) with provable coverage guarantees. For deep networks, we demonstrate that Euclidean certification is rendered vacuous by spectral amplification -- a mechanism where the inherent ill-conditioning of deep representations inflates Lipschitz bounds by over $10{,}000\times$. This explains why standard TRAK scores, while accurate point estimates, are geometrically fragile: naive Euclidean robustness analysis yields 0\% certification. Our key contribution is the Natural Wasserstein metric, which measures perturbations in the geometry induced by the model's own feature covariance. This eliminates spectral amplification, reducing worst-case sensitivity by $76\times$ and stabilizing attribution estimates. On CIFAR-10 with ResNet-18, Natural W-TRAK certifies 68.7\% of ranking pairs compared to 0\% for Euclidean baselines -- to our knowledge, the first non-vacuous certified bounds for neural network attribution. Furthermore, we prove that the Self-Influence term arising from our analysis equals the Lipschitz constant governing attribution stability, providing theoretical grounding for leverage-based anomaly detection. Empirically, Self-Influence achieves 0.970 AUROC for label noise detection, identifying 94.1\% of corrupted labels by examining just the top 20\% of training data.

Learned image reconstruction has become a pillar in computational imaging and inverse problems. Among the most successful approaches are learned iterative networks, which are formulated by unrolling classical iterative optimisation algorithms for solving variational problems. While the underlying algorithm is usually formulated in the functional analytic setting, learned approaches are often viewed as purely discrete. In this chapter we present a unified operator view for learned iterative networks. Specifically, we formulate a learned reconstruction operator, defining how to compute, and separately the learning problem, which defines what to compute. In this setting we present common approaches and show that many approaches are closely related in their core. We review linear as well as nonlinear inverse problems in this framework and present a short numerical study to conclude.